synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD092780 | 0.22 | 434.43 | C17H18O6N6S | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@@H]3O)c2n1 |
|
GD085840 | 0.64 | 419.42 | C17H17O6N5S | O=[N+]([O-])c1ccc(CSc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)cc1 |
|
GD089146 | -0.24 | 448.38 | C21H20O11 | O=c1c(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12 |
|
GD104120 | 1.76 | 493.51 | C24H31O10N | C/C=C/c1ccc(O[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2NC(C)=O)c(OC)c1 |
|
GD104570 | 1.45 | 463.48 | C23H29O9N | C=CCc1ccccc1O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1NC(C)=O |
|
GD061645 | -0.26 | 337.37 | C17H23O6N | C=CCc1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1NC(C)=O |
|
GD099659 | 0.96 | 452.41 | C21H24O11 | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD092923 | 1.46 | 438.43 | C21H26O10 | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C)cc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD043972 | -1.33 | 268.27 | C12H16O5N2 | OC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)c1nc2ccccc2[nH]1 |
|
GD103520 | 0.41 | 496.43 | C21H24O12N2 | CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](OC(C)=O)[C@H]1OC(C)=O |